ethyl 2-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-4-carboxylate

Systemtic Name: ethyl 2-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-4-carboxylate Openeye Name: ethyl 2-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-4-carboxylate CAS Name: 2-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-4-carboxylate Traditional Name: 2-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-4-carboxylic acid ethyl ester Formula: C13H18N2O2 MolecularWeight: 234.29422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(NC2=CC=CC=C2N1)C

Isomeric SMILES

CCOC(=O)C1CC(NC2=CC=CC=C2N1)C

InChI

InChI=1S/C13H18N2O2/c1-3-17-13(16)12-8-9(2)14-10-6-4-5-7-11(10)15-12/h4-7,9,12,14-15H,3,8H2,1-2H3